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(4S*,6S*)-4-BUT-(1E)-ENYL-4,6-DIHYDROXY-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE
SpectraBase Compound ID 7SnIumhnLqM
InChI InChI=1S/C13H20O3/c1-5-6-7-13(16)9(2)8-10(14)11(15)12(13,3)4/h6-8,11,15-16H,5H2,1-4H3/b7-6+/t11-,13+/m1/s1
InChIKey VWOYCFRFXIOOPK-VKYBYORPSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7VPNsYNvLs
Name (4S*,6S*)-4-BUT-(1E)-ENYL-4,6-DIHYDROXY-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-5-6-7-13(16)9(2)8-10(14)11(15)12(13,3)4/h6-8,11,15-16H,5H2,1-4H3/b7-6+/t11-,13+/m1/s1
InChIKey VWOYCFRFXIOOPK-VKYBYORPSA-N
Literature Reference Author L.S.LIMA,M.V.B.LIMA,J.P.DAVID,A.M.GIULIETTI,L.P.D.QUIROZ,J.M .DAVID
Literature Reference Citation J.BRAZ.CHEM.SOC.,20,1921(2009)
Literature Reference DOI 10.1590/s0103-50532009001000022
Molecular Weight 224.300 g/mol
Source File Reference UWBT6283